4-(3-Carboxypropanamido)benzoic acid

Base Information

• Chemical Name: 4-(3-Carboxypropanamido)benzoic acid
• CAS No.: 76475-62-2
• Molecular Formula: C11H11 N O5
• Molecular Weight: 237.212
• DSSTox Substance ID: DTXSID40354175
• Nikkaji Number: J1.465.213B
• Wikidata: Q82132176
• Mol file: 76475-62-2.mol

Synonyms:76475-62-2;N-(4-Carboxyphenyl)succinamic acid;4-(3-carboxypropanamido)benzoic acid;4-(3-carboxypropanoylamino)benzoic acid;4-[(3-carboxypropanoyl)amino]benzoic acid;CBDivE_005741;MFCD00020530;CBKinase1_000202;CBKinase1_012602;Cambridge id 5122038;Oprea1_520562;Oprea1_699317;Oprea1_777750;CBDivE_001323;SCHEMBL7824720;DTXSID40354175;N-(4-Carboxyphenyl)succinamidic acid;STK023953;AKOS001570700;N-(4-Carboxyphenyl)succinamic acid, 96%;4-(3-CARBAMOYLPROPANOYL)BENZOIC ACID;CS-0322479;F78081;SR-01000393446;SR-01000393446-1;BRD-K30217641-001-01-2;F0345-1020;Boc-(S)-3-Amino-3-(3,5-dimethoxy-phenyl)-propionicacid

Chemical Property of 4-(3-Carboxypropanamido)benzoic acid

Chemical Property:

• Melting Point: 235-236 °C(lit.)
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 237.06372245
• Heavy Atom Count: 17
• Complexity: 307

Purity/Quality:

99% ^*data from raw suppliers

N-(4-Carboxyphenyl)succinamic acid 96% ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1C(=O)O)NC(=O)CCC(=O)O

Technology Process of 4-(3-Carboxypropanamido)benzoic acid

There total 4 articles about 4-(3-Carboxypropanamido)benzoic acid which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

succinic acid anhydride (108-30-5) + 4-amino-benzoic acid (150-13-0,159246-81-8,8014-65-1) → 4-(2-carboxyethylcarboxamido)benzoic acid (76475-62-2)

Guidance literature:

With potassium carbonate;

Reference yield:

N-(p-tolyl)succinimide (2314-79-6) → 4-(2-carboxyethylcarboxamido)benzoic acid (76475-62-2)

Guidance literature:

With potassium permanganate; water;

Reference yield:

p-toluidine (106-49-0,12221-03-3) → 4-(2-carboxyethylcarboxamido)benzoic acid (76475-62-2)

Guidance literature:

Multi-step reaction with 2 steps

1: beim Zusammenschmelzen

2: potassium permanganate; water

With potassium permanganate; water;

upstream raw materials:

succinic acid anhydride

4-amino-benzoic acid

4-(benzylideneimino)benzoic acid

N-(p-tolyl)succinimide

Downstream raw materials:

4-amino-benzoic acid

succinic acid

4-(2,5-dioxo-1-pyrrolidinyl)benzoic acid

(4-sulfamoylphenylcarbamoyl)methyl 4-(2,5-dioxopyrrolidin-1-yl)benzoate

Refernces

• 1、 Correa-Basurto, Jose,Alcantara, Ivan Vazquez,Espinoza-Fonseca, L. Michel,Trujillo-Ferrara, Jose G.. "p-Aminobenzoic acid derivatives as acetylcholinesterase inhibitors". . p. 732 - 735. Retrieved 2007/10/03.